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DocumentationIdentifier: MM130494
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM130494 |
| SMILES |
NC(=O)C=CC(F)(F)F
|
| InChIKey |
UUJWVXVMQOGZID-UHFFFAOYSA-N
|
| MW [Da] |
139.08
Automatically obtained from RDkit software. |
| LogP |
0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM263920
Similarity: 0.8429
Similarity to MM263920
| Tanimoto metric | 0.8429 |
|---|---|
| Cosine metric | 0.9181 |
| Dice metric | 0.9147 |
| MW: | 121.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM145700
Similarity: 0.6484
Similarity to MM145700
| Tanimoto metric | 0.6484 |
|---|---|
| Cosine metric | 0.7884 |
| Dice metric | 0.7867 |
| MW: | 135.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM221639
Similarity: 0.6481
Similarity to MM221639
| Tanimoto metric | 0.6481 |
|---|---|
| Cosine metric | 0.8051 |
| Dice metric | 0.7865 |
| MW: | 153.1 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+165 more
